* LIGAND DATABASE FILE (OPLS2005)
*
001      62    61    106    151     305
    1     0 S   NP   _N1_     1    27.95582    96.56891   -20.78305
    2     1 S   H    _HN1     2     1.02957    79.29228     9.97502
    3     1 S   H    _H1_     3     1.02837    33.59281   155.52315
    4     1 S   H    _H2_     4     1.02779    99.89673   -96.98685
    5     1 S   CT   _CA1     5     1.50114   140.15012   119.09535
    6     5 S   HC   _HA1     6     1.09569   105.25557    79.78571
    7     5 S   CO3  _C1_     7     1.53808   112.30301   -40.53546
    8     7 S   O2Z  _O11     8     1.26374   115.00755   -45.43576
    9     7 S   O2Z  _O12     9     1.26231   114.92890   133.62672
   10     5 S   CT   _CB1    10     1.53058   107.43200  -162.21522
   11    10 S   HC   HB11    11     1.09835   109.55422   -50.08889
   12    10 S   HC   HB12    12     1.09730   110.26504    66.33714
   13    10 S   CT   _CG1    13     1.53021   112.61956  -170.98740
   14    13 S   HC   HG11    14     1.09579   110.75473   -62.55163
   15    13 S   HC   HG12    15     1.09650   109.69360    56.63984
   16    13 S   C    _CD1    16     1.51773   112.12601   177.57731
   17    16 S   O    _OE1    17     1.22774   123.16168    12.38072
   18    16 S   N    _N2_    18     1.38567   111.90157  -168.12139
   19    18 S   H    _HN2    19     1.01517   119.35938     2.28927
   20    18 S   CT1  _CA2    20     1.45877   122.58926  -178.09166
   21    20 S   HC   _HA2    21     1.09576   108.05123    37.99117
   22    20 S   C    _C2_    22     1.52985   107.36558   -79.18609
   23    22 S   O    _O2_    23     1.23016   122.97897   -29.86933
   24    20 S   CT   _CB2    32     1.53361   112.39262   161.88986
   25    24 S   HC   HB21    33     1.09733   109.18665    57.83630
   26    24 S   HC   HB22    34     1.09559   111.58610   174.11317
   27    22 S   N    _N3_    24     1.38533   112.67524   152.85251
   28    27 S   H    _HN3    25     1.01731   120.24723    -1.41181
   29    24 S   S    _SG2    35     1.82279   113.72161   -60.35884
   30    27 S   CT   _CA3    26     1.45344   122.22327   178.81205
   31    30 S   HC   HA31    27     1.09577   107.54453   -60.19627
   32    30 S   HC   HA32    28     1.09575   107.77309    55.99749
   33    29 S   CMA  _C12    36     1.81713   103.82991   -76.18158
   34    33 S   OM   _O33    37     1.26808   120.69580   -12.51063
   35    30 S   CO3  _C3_    29     1.52831   114.66931   177.90837
   36    35 S   O2Z  _O31    30     1.26281   116.19311    -3.05595
   37    35 S   O2Z  _O32    31     1.26480   114.34585   177.00814
   38    33 S   CM   _C10    38     1.36800   112.45173   167.54969
   39    38 S   CO4  _C9_    39     1.51021   117.53432  -179.38515
   40    39 S   O    _O34    40     1.23485   118.50046   -74.65501
   41    38 S   CT   _C11    59     1.50610   128.64055     3.01123
   42    41 S   HC   _H10    60     1.09459   110.89255   -73.19989
   43    41 S   HC   _H11    61     1.09474   111.53829   166.81855
   44    41 S   HC   _H12    62     1.09482   111.49993    48.75314
   45    39 S   CT   _C7_    41     1.55222   119.26775   105.92795
   46    45 S   SM   _S1_    42     1.89246   106.76399   114.19095
   47    45 S   CM   _C6_    43     1.52401   114.64307    -0.84696
   48    47 S   HC   _H6_    44     1.09366   114.12745    88.48610
   49    45 S   CT   _C8_    55     1.54199   109.61497  -133.40035
   50    49 S   HC   _H7_    56     1.09861   112.70163   -67.38580
   51    49 S   HC   _H8_    57     1.09712   112.13729   171.17363
   52    49 S   HC   _H9_    58     1.09401   111.68515    49.91828
   53    47 S   CM   _C5_    45     1.35322   131.21823   -91.17909
   54    53 S   CM   _C13    46     1.46582   118.02301  -177.21639
   55    54 S   HC   _H13    47     1.08927   116.48247    -5.09655
   56    53 S   CT   _C4_    51     1.50319   124.96524     4.59171
   57    56 S   HC   _H3_    52     1.09467   110.64263  -104.30728
   58    56 S   HC   _H4_    53     1.08853   112.95953    17.60067
   59    56 S   HC   _H5_    54     1.09542   111.17952   134.88136
   60    54 S   CM   _C14    48     1.33901   127.14002   173.83188
   61    60 S   HC   _H14    49     1.08564   119.85244  -179.60238
   62    60 S   HC   _H15    50     1.08360   123.10755     0.19180
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   7   3   2   7   4   5   5   4   3
   9   3   2   1   1  10  14   5   4   2   1   1  10   7  13   4
   4   2   1   1   9   8   4   4   2   1   1   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    41  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    45    41    42    43    44  
   38    39    41  
   36    37  
   37  
    0  
   39    40    45    46    47    49    41    42    43    44  
   40    45    46    47    48    53    49    50    51    52    41    42    43    44  
   45    46    47    49    41  
   42    43    44    45  
   43    44  
   44  
    0  
   46    47    48    53    54    56    49    50    51    52  
   47    48    53    49    50    51    52  
   48    53    54    55    60    56    57    58    59    49    50    51    52  
   53    54    56    49  
   50    51    52    53  
   51    52  
   52  
    0  
   54    55    60    61    62    56    57    58    59  
   55    60    61    62    56    57    58    59  
   60    61    62    56  
   57    58    59    60  
   58    59  
   59  
    0  
   61    62  
   62  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.575000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5500   0.0760   0.382600   2.0020   1.7750   0.023028004  -0.852763146
   34   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   39   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   40   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   41   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   3.5000   0.0660  -0.100000   1.9750   1.7500   0.005000000  -0.741685710
   46   3.6000   0.3550  -0.900000   2.0300   1.8000   0.025682759  -1.666211680
   47   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   48   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   49   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   54   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   55   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   61   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   62   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   240.000  1.763
   33    34   745.000  1.250
   33    38   465.000  1.376
   38    39   320.000  1.462
   38    41   317.000  1.510
   39    40   570.000  1.229
   39    45   317.000  1.522
   45    46   222.000  1.810
   45    47   317.000  1.510
   45    49   268.000  1.529
   47    48   340.000  1.080
   47    53   549.000  1.340
   53    54   380.000  1.444
   53    56   317.000  1.510
   54    55   340.000  1.080
   54    60   549.000  1.340
   60    61   340.000  1.080
   60    62   340.000  1.080
   56    57   340.000  1.090
   56    58   340.000  1.090
   56    59   340.000  1.090
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    52   340.000  1.090
   41    42   340.000  1.090
   41    43   340.000  1.090
   41    44   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    85.00000  102.41200
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    95.00000  113.88000
   29    33    38    65.00000  122.11800
   33    38    39    60.00000  125.92000
   33    38    41    70.00000  124.00000
   38    33    34    65.00000  137.10300
   38    39    40    80.00000  123.72100
   38    39    45    65.00000  118.62400
   38    41    42    35.00000  109.50000
   38    41    43    35.00000  109.50000
   38    41    44    35.00000  109.50000
   39    45    46    75.00000  110.18000
   39    45    47    70.00000  109.06800
   39    45    49    63.00000  111.10000
   45    39    40    80.00000  120.40000
   45    47    48    35.00000  117.00000
   45    47    53    70.00000  124.00000
   45    49    50    37.50000  110.70000
   45    49    51    37.50000  110.70000
   45    49    52    37.50000  110.70000
   47    45    46    75.00000  112.20000
   47    53    54    70.00000  123.01800
   47    53    56    70.00000  124.00000
   53    47    48    35.00000  120.00000
   53    54    55    35.00000  120.00000
   53    54    60    70.00000  123.01800
   53    56    57    35.00000  109.50000
   53    56    58    35.00000  109.50000
   53    56    59    35.00000  109.50000
   54    60    61    35.00000  120.00000
   54    60    62    35.00000  120.00000
   60    54    55    35.00000  120.00000
   62    60    61    35.00000  117.00000
   56    53    54    70.00000  124.00000
   58    56    57    33.00000  107.80000
   59    56    57    33.00000  107.80000
   59    56    58    33.00000  107.80000
   49    45    46    75.00000  111.63000
   49    45    47    70.00000  112.02700
   51    49    50    33.00000  107.80000
   52    49    50    33.00000  107.80000
   52    49    51    33.00000  107.80000
   41    38    39    65.00000  116.34900
   43    41    42    33.00000  107.80000
   44    41    42    33.00000  107.80000
   44    41    43    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.00000  1.0 1.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    35    36   0.00000  1.0 1.0
   27    30    35    37   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   1.00000 -1.0 2.0
   24    29    33    38   1.00000 -1.0 2.0
   25    24    29    33   0.24000  1.0 3.0
   26    24    29    33   0.24000  1.0 3.0
   29    33    38    39   7.00000 -1.0 2.0
   29    33    38    41   7.00000 -1.0 2.0
   33    38    39    40   1.00000 -1.0 2.0
   33    38    39    45  -0.33500  1.0 1.0
   33    38    39    45   1.06600 -1.0 2.0
   33    38    39    45  -0.14000  1.0 3.0
   33    38    41    42   0.00000  1.0 1.0
   33    38    41    43   0.00000  1.0 1.0
   33    38    41    44   0.00000  1.0 1.0
   34    33    38    39   7.00000 -1.0 2.0
   34    33    38    41   7.00000 -1.0 2.0
   38    39    45    46   0.65300  1.0 1.0
   38    39    45    46  -0.03850 -1.0 2.0
   38    39    45    46   0.33900  1.0 3.0
   38    39    45    47   0.65300  1.0 1.0
   38    39    45    47  -0.03850 -1.0 2.0
   38    39    45    47   0.33900  1.0 3.0
   38    39    45    49   0.65300  1.0 1.0
   38    39    45    49  -0.03850 -1.0 2.0
   38    39    45    49   0.33900  1.0 3.0
   39    38    41    42   0.15000  1.0 3.0
   39    38    41    43   0.15000  1.0 3.0
   39    38    41    44   0.15000  1.0 3.0
   39    45    47    48   0.00000  1.0 1.0
   39    45    47    53  -0.51250  1.0 1.0
   39    45    47    53  -0.88800 -1.0 2.0
   39    45    47    53   0.08850  1.0 3.0
   39    45    49    50  -0.11250  1.0 3.0
   39    45    49    51  -0.11250  1.0 3.0
   39    45    49    52  -0.11250  1.0 3.0
   40    39    45    46   0.30150 -1.0 2.0
   40    39    45    47   0.30150 -1.0 2.0
   40    39    45    49   0.30150 -1.0 2.0
   45    47    53    54   7.00000 -1.0 2.0
   45    47    53    56   7.00000 -1.0 2.0
   46    45    47    48   0.00000  1.0 1.0
   46    45    47    53   0.42700  1.0 1.0
   46    45    47    53  -0.70350 -1.0 2.0
   46    45    47    53  -0.43150  1.0 3.0
   46    45    49    50   0.15000  1.0 3.0
   46    45    49    51   0.15000  1.0 3.0
   46    45    49    52   0.15000  1.0 3.0
   47    45    49    50   0.15000  1.0 3.0
   47    45    49    51   0.15000  1.0 3.0
   47    45    49    52   0.15000  1.0 3.0
   47    53    54    55  -0.18600  1.0 3.0
   47    53    54    60   0.28850  1.0 1.0
   47    53    54    60   2.61350 -1.0 2.0
   47    53    54    60   0.78400  1.0 3.0
   47    53    56    57   0.00000  1.0 1.0
   47    53    56    58   0.00000  1.0 1.0
   47    53    56    59   0.00000  1.0 1.0
   48    47    53    54   7.00000 -1.0 2.0
   48    47    53    56   7.00000 -1.0 2.0
   53    54    60    61   7.00000 -1.0 2.0
   53    54    60    62   7.00000 -1.0 2.0
   54    53    56    57   0.00000  1.0 1.0
   54    53    56    58   0.00000  1.0 1.0
   54    53    56    59   0.00000  1.0 1.0
   55    54    60    61   7.00000 -1.0 2.0
   55    54    60    62   7.00000 -1.0 2.0
   56    53    54    55   0.00000  1.0 1.0
   56    53    54    60  -0.18600  1.0 3.0
   49    45    47    48   0.00000  1.0 1.0
   49    45    47    53   0.09850  1.0 1.0
   49    45    47    53   0.15250 -1.0 2.0
   49    45    47    53  -0.50650  1.0 3.0
   41    38    39    40  -0.64400  1.0 1.0
   41    38    39    40   0.26850 -1.0 2.0
   41    38    39    45   0.25700  1.0 1.0
   41    38    39    45   0.66200 -1.0 2.0
   41    38    39    45   0.04450  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
   29    34    33    38  15.00000 -1.0 2.0
   39    41    38    33  15.00000 -1.0 2.0
   38    45    39    40  10.50000 -1.0 2.0
   45    48    47    53  15.00000 -1.0 2.0
   54    56    53    47  15.00000 -1.0 2.0
   53    55    54    60  15.00000 -1.0 2.0
   61    62    60    54  15.00000 -1.0 2.0
END
